CAS 939986-26-2

1,1-Dimethylethyl 4-(4-methyl-2-pyridinyl)-1-piperazinecarboxylate

Description:

1,1-Dimethylethyl 4-(4-methyl-2-pyridinyl)-1-piperazinecarboxylate, identified by its CAS number 939986-26-2, is a chemical compound that belongs to the class of piperazine derivatives. This substance features a piperazine ring, which is a six-membered cyclic amine, and is substituted with a carboxylate group and a pyridine moiety. The presence of the 1,1-dimethylethyl group contributes to its steric bulk, potentially influencing its biological activity and solubility. The compound may exhibit pharmacological properties, making it of interest in medicinal chemistry, particularly in the development of therapeutic agents. Its structure suggests potential interactions with biological targets, which could be explored in drug discovery. As with many organic compounds, its stability, reactivity, and solubility can vary based on environmental conditions. Safety data and handling precautions should be consulted when working with this compound, as with any chemical substance, to ensure proper laboratory practices.

Formula: C₁₅H₂₃N₃O₂

InChI: InChI=1S/C15H23N3O2/c1-12-5-6-16-13(11-12)17-7-9-18(10-8-17)14(19)20-15(2,3)4/h5-6,11H,7-10H2,1-4H3

InChI key: InChIKey=CNUPZJGHICNMJM-UHFFFAOYSA-N

SMILES: CC=1C=C(N2CCN(C(OC(C)(C)C)=O)CC2)N=CC1

Synonyms:

• 1-Piperazinecarboxylic acid, 4-(4-methyl-2-pyridinyl)-, 1,1-dimethylethyl ester
• 1,1-Dimethylethyl 4-(4-methyl-2-pyridinyl)-1-piperazinecarboxylate